Presentation Information
[D341-2vn-03]Integration of Quantum Chemical Calculation and Molecular Dynamics Simulation: A Novel Approach for the Organometallic-Catalyzed Thermosetting Polymers
○YUKUN BAI1, Naoki Kishimoto1, gota kikugawa2 (1. Graduate School of Science, Tohoku University, 2. Institute of Fluid Science, Tohoku University)
Keywords:
Quantum Chemistry Calculation,Molecular Dynamics Simulation,Thermosetting Polymer,Cyanate Resin